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146943-96-6 | 1,5,7,8,14-Pentadecapentaene, 5-(1-propynyl)-, (Z)- (9CI)
CAS No: 146943-96-6 Catalog No: AG001EGZ MDL No:
Product Description
Catalog Number:
AG001EGZ
Chemical Name:
1,5,7,8,14-Pentadecapentaene, 5-(1-propynyl)-, (Z)- (9CI)
CAS Number:
146943-96-6
Molecular Formula:
C18H24
Molecular Weight:
240.3832
IUPAC Name:
5-prop-1-ynylpentadeca-1,5,7,8,14-pentaene
InChI:
InChI=1S/C18H24/c1-4-7-9-10-11-12-13-14-17-18(15-6-3)16-8-5-2/h4-5,12,14,17H,1-2,7-11,16H2,3H3
InChI Key:
CXHKQNFKZTTZSV-UHFFFAOYSA-N
SMILES:
C=CCCCCC=C=C/C=C(\C#CC)/CCC=C
Properties
Complexity:
386
Compound Is Canonicalized:
No
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
240.188g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
0
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
240.39g/mol
Monoisotopic Mass:
240.188g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
6
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